| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 11th, 2008 | 25 | Yes |
Popular Name: 1H-1,4-Diazepine-5-carboxylic acid, hexahydro-1,4-bis(phenylmethyl)-, methyl ester 1H-1,4-Diazepine-5-carboxylic ac…
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CAS Number: 220364-79-4
1H-1,4-Diazepine-5-carboxylicacid, hexahydro-1,4-bis(phenylmethyl)-methylester,dihydrochloride
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 3.15 | 10.47 | -40.31 | 1 | 4 | 1 | 34 | 339.459 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.15 | 10.22 | -30.69 | 1 | 4 | 1 | 34 | 339.459 | 6 | ↓ |
